AG000DBB

Name: 4-[(Ethylsulfonyl)amino]benzoic Acid
Brand: Angene Chemical
SKU: AG000DBB

116855-56-2 | 4-[(Ethylsulfonyl)amino]benzoic Acid

AG000DBB

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CAS Number	116855-56-2
Catalog Number	AG000DBB(AGN-PC-0K6AWC)
Chemical Name	4-[(Ethylsulfonyl)amino]benzoic Acid
IUPAC Name	4-(ethylsulfonylamino)benzoic acid
InChI	InChI=1S/C9H11NO4S/c1-2-15(13,14)10-8-5-3-7(4-6-8)9(11)12/h3-6,10H,2H2,1H3,(H,11,12)
InChI Key	ZFKRSHTUEJDCLL-UHFFFAOYSA-N
MDL Number	MFCD03764807
Molecular Formula	C9H11NO4S
Molecular Weight	229.2529
SMILES	S(CC)(=O)(=O)NC1C=CC(=CC=1)C(O)=O
Synonyms	4-[(ethylsulfonyl)amino]benzoic acid, 116855-56-2, 4-ethanesulfonylaminobenzoic acid, Benzoic acid, 4-[(ethylsulfonyl)amino]-, AC1LTX1E, SCHEMBL1017480, 4-(Ethylsulfonamido)benzoic acid, CTK4B0026, A3041/0128382, DTXSID30363953, ZFKRSHTUEJDCLL-UHFFFAOYSA-N, 4-(ethylsulfonylamino)benzoic acid, ALBB-029542, ZINC1438781, BBL019874, MFCD03764807, STK662074, AKOS000125202, MCULE-9842642201, SC-57523, BENZOIC ACID,4-[(ETHYLSULFONYL)AMINO]-, Y-0821, CID1516261,

Complexity	312
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	229.041g/mol
Formal Charge	0
Heavy Atom Count	15
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	229.25g/mol
Monoisotopic Mass	229.041g/mol
Rotatable Bond Count	4
Topological Polar Surface Area	91.8A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0.8

CERTIFICATE OF ANALYSIS

Analysis Data:

Test:

Result:

Conclusion: The above product meets the specifications of Angene.

Analyst:Chase

Date:

Reviewed by:Jessie

Date:

Angene International Limited